[5-methyl-6-(3-propan-2-ylphenoxy)-3-pyridinyl]methanol

C16H19NO2 — CID 80628637

IUPAC[5-methyl-6-(3-propan-2-ylphenoxy)-3-pyridinyl]methanol
SMILESCc1cc(CO)cnc1Oc1cccc(C(C)C)c1
InChIInChI=1S/C16H19NO2/c1-11(2)14-5-4-6-15(8-14)19-16-12(3)7-13(10-18)9-17-16/h4-9,11,18H,10H2,1-3H3
InChIKeyOKIJSVXYSIDQBE-UHFFFAOYSA-N
MW257.33 g/mol
LogP3.80
Rot. Bonds4

About [5-methyl-6-(3-propan-2-ylphenoxy)-3-pyridinyl]methanol

[5-methyl-6-(3-propan-2-ylphenoxy)-3-pyridinyl]methanol (PubChem CID 80628637) has the molecular formula C16H19NO2 and a molecular weight of 257.33 g/mol. Its IUPAC name is [5-methyl-6-(3-propan-2-ylphenoxy)-3-pyridinyl]methanol.

Molecular Properties

Compound Name[5-methyl-6-(3-propan-2-ylphenoxy)-3-pyridinyl]methanol
PubChem CID80628637
Molecular FormulaC16H19NO2
Molecular Weight257.33 g/mol
Exact Mass257.14
IUPAC Name[5-methyl-6-(3-propan-2-ylphenoxy)-3-pyridinyl]methanol
SMILESCc1cc(CO)cnc1Oc1cccc(C(C)C)c1
InChIInChI=1S/C16H19NO2/c1-11(2)14-5-4-6-15(8-14)19-16-12(3)7-13(10-18)9-17-16/h4-9,11,18H,10H2,1-3H3
InChIKeyOKIJSVXYSIDQBE-UHFFFAOYSA-N
XLogP3.80
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.33
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(5-methyl-6-naphthalen-2-yloxy-3-pyridinyl)methanol
CID 80629021
[6-(3,4-dimethylphenoxy)-5-methyl-3-pyridinyl]methanol
CID 80628087
[6-[3-(dimethylamino)phenoxy]-5-methyl-3-pyridinyl]methanol
CID 80628307
[5-methyl-6-(3-nitrophenoxy)-3-pyridinyl]methanol
CID 80629220
[6-(4-bromo-3-fluorophenoxy)-5-methyl-3-pyridinyl]methanol
CID 80628936
[6-(2,3-dichlorophenoxy)-5-methyl-3-pyridinyl]methanol
CID 80629406
[6-(2-ethoxyphenoxy)-5-methyl-3-pyridinyl]methanol
CID 80628736
[5-methyl-6-[(2-methyl-3-pyridinyl)oxy]-3-pyridinyl]methanol
CID 80628218
5-(chloromethyl)-2-(3-propan-2-ylphenoxy)pyrimidine
CID 113387977
N-methyl-1-[5-methyl-6-(4-propan-2-ylphenoxy)-3-pyridinyl]methanamine
CID 80635782
6-[3-(hydroxymethyl)phenoxy]-5-methylpyridine-3-carbaldehyde
CID 80631507
N,5-dimethyl-4-(3-propan-2-ylphenoxy)pyrimidin-2-amine
CID 80864328

Frequently Asked Questions

What is the IUPAC name of [5-methyl-6-(3-propan-2-ylphenoxy)-3-pyridinyl]methanol?
The IUPAC name of [5-methyl-6-(3-propan-2-ylphenoxy)-3-pyridinyl]methanol (CID 80628637) is [5-methyl-6-(3-propan-2-ylphenoxy)-3-pyridinyl]methanol.
What is the SMILES notation for [5-methyl-6-(3-propan-2-ylphenoxy)-3-pyridinyl]methanol?
The canonical SMILES for [5-methyl-6-(3-propan-2-ylphenoxy)-3-pyridinyl]methanol is Cc1cc(CO)cnc1Oc1cccc(C(C)C)c1.
What is the InChIKey of [5-methyl-6-(3-propan-2-ylphenoxy)-3-pyridinyl]methanol?
The InChIKey is OKIJSVXYSIDQBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO2/c1-11(2)14-5-4-6-15(8-14)19-16-12(3)7-13(10-18)9-17-16/h4-9,11,18H,10H2,1-3H3.
What are the key properties of [5-methyl-6-(3-propan-2-ylphenoxy)-3-pyridinyl]methanol?
[5-methyl-6-(3-propan-2-ylphenoxy)-3-pyridinyl]methanol has a molecular weight of 257.33 g/mol, XLogP of 3.80, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [5-methyl-6-(3-propan-2-ylphenoxy)-3-pyridinyl]methanol is sourced from PubChem (CID 80628637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).